Geometry & MOs

Info

ID:	130015
PubChem CID:	51074614
Reduced:	OF3N6H9C13 (1)
Stoich.:	AB3C6D9E13 (1)
Weight, g/mol:	319.189592
ΔH_f, kcal/mol:	-68.99
Dipole, Da:	5.64
IP(EA), eV:	-9.56(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

morpholin-4-yl-[4-(2-phenoxyethyl)piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)N)NC2=NN3C(=NN=C3C(F)(F)F)C=C2

DOS

IR

Vibrations